Description
Ghemical is a computational chemistry application. Ghemical is written in C++. It has a graphical user interface (in fact, a couple of them), and it supports both quantum-mechanics (semi-empirical and ab initio) models and molecular mechanics models (there is an experimental Tripos 5.2-like force field for organic molecules). Also a tool for reduced protein models is included. Geometry optimization, molecular dynamics and a large set of visualization tools are currently available.
Installation Instructions
Instructions not filled in by author. Author knows what to do. Everybody else should avoid this repo.
Active Releases
The following unofficial repositories are provided as-is by owner of this project. Contact the owner directly for bugs or issues (IE: not bugzilla).
| Release | Architectures | Repo Download |
|---|---|---|
EPEL 6
|
i386 (0)*, x86_64 (0)* | EPEL 6 (0 downloads) |
* Total number of downloaded packages.
External Repository List
The following repositories are accessible during builds